[1-[(1-cyano-2-phenylmethoxy-ethyl)-methyl-amino]-3-cyclopropyl-1-oxidanylidene-propan-2-yl] N-(phenylmethyl)carbamate

Systemtic Name: [1-[(1-cyano-2-phenylmethoxy-ethyl)-methyl-amino]-3-cyclopropyl-1-oxidanylidene-propan-2-yl] N-(phenylmethyl)carbamate Openeye Name: [2-[(2-benzyloxy-1-cyano-ethyl)-methyl-amino]-1-(cyclopropylmethyl)-2-oxo-ethyl] N-benzylcarbamate CAS Name: N-(phenylmethyl)carbamic acid [1-[(1-cyano-2-phenylmethoxyethyl)-methylamino]-3-cyclopropyl-1-oxopropan-2-yl] ester IUPAC Name: [1-[(1-cyano-2-phenylmethoxyethyl)-methylamino]-3-cyclopropyl-1-oxopropan-2-yl] N-benzylcarbamate Traditional Name: N-benzylcarbamic acid [2-[(2-benzoxy-1-cyano-ethyl)-methyl-amino]-1-(cyclopropylmethyl)-2-keto-ethyl] ester Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(COCC1=CC=CC=C1)C#N)C(=O)C(CC2CC2)OC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CN(C(COCC1=CC=CC=C1)C#N)C(=O)C(CC2CC2)OC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C25H29N3O4/c1-28(22(15-26)18-31-17-21-10-6-3-7-11-21)24(29)23(14-19-12-13-19)32-25(30)27-16-20-8-4-2-5-9-20/h2-11,19,22-23H,12-14,16-18H2,1H3,(H,27,30)